N-[[5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl]-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[[5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl]-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[[5-(3,4-dimethoxyphenyl)isoxazol-3-yl]methyl]-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-[[5-(3,4-dimethoxyphenyl)-3-isoxazolyl]methyl]-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-[[5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl]-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-[[5-(3,4-dimethoxyphenyl)isoxazol-3-yl]methyl]-2-(methylthio)nicotinamide Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=NO2)CNC(=O)C3=C(N=CC=C3)SC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=NO2)CNC(=O)C3=C(N=CC=C3)SC)OC

InChI

InChI=1S/C19H19N3O4S/c1-24-15-7-6-12(9-17(15)25-2)16-10-13(22-26-16)11-21-18(23)14-5-4-8-20-19(14)27-3/h4-10H,11H2,1-3H3,(H,21,23)